| SpectraBase Compound ID | CH3CYTWTEwS |
|---|---|
| InChI | InChI=1S/C10H8N2O2S/c1-7(13)14-9-4-2-8(3-5-9)10-6-15-12-11-10/h2-6H,1H3 |
| InChIKey | JESSYNCAGSGAON-UHFFFAOYSA-N |
| Mol Weight | 220.25 g/mol |
| Molecular Formula | C10H8N2O2S |
| Exact Mass | 220.030649 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | nrnkCDnCbt |
|---|---|
| Name | p-(1,2,3-Thiadiazol-4-yl)phenol, acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.030648678 u |
| Formula | C10H8N2O2S |
| InChI | InChI=1S/C10H8N2O2S/c1-7(13)14-9-4-2-8(3-5-9)10-6-15-12-11-10/h2-6H,1H3 |
| InChIKey | JESSYNCAGSGAON-UHFFFAOYSA-N |
| Molecular Weight | 220.246 g/mol |
| SMILES | C=1C(=CC=C(C1)C=1N=NSC1)OC(C)=O |